4-[4-ethyl-3-(4-hydroxyphenyl)-2-(2-methylpropyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-ethyl-3-(4-hydroxyphenyl)-2-(2-methylpropyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-ethyl-3-(4-hydroxyphenyl)-2-isobutyl-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-ethyl-3-(4-hydroxyphenyl)-2-(2-methylpropyl)-1H-pyrazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-ethyl-3-(4-hydroxyphenyl)-2-(2-methylpropyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-ethyl-5-(4-hydroxyphenyl)-1-isobutyl-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C21H24N2O2 MolecularWeight: 336.42746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(NC1=C2C=CC(=O)C=C2)CC(C)C)C3=CC=C(C=C3)O

Isomeric SMILES

CCC1=C(N(NC1=C2C=CC(=O)C=C2)CC(C)C)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H24N2O2/c1-4-19-20(15-5-9-17(24)10-6-15)22-23(13-14(2)3)21(19)16-7-11-18(25)12-8-16/h5-12,14,22,25H,4,13H2,1-3H3